input word = C00001789

Metabolite InformationStructural formula
Name Yohimbine
Formula C21H26N2O3
Mw 354.19434271
CAS RN 146-48-5
C_ID C00001789 ,
InChIKey BLGXFZZNTVWLAY-BBMZDAOJNA-N
InChICode InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1
SMILES c12c3c([nH]c1[C@H]1N(CC2)C[C@H]2[C@H](C1)[C@H]([C@H](CC2)O)C(=O)OC)cccc3
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens Ref.
PlantaeApocynaceaeHaplophyton crooksii L.Benson Ref.
PlantaeApocynaceaeRauvolfia nitida Ref.
PlantaeApocynaceaeRauvolfia serpentina Ref.
PlantaeApocynaceaeRauvolfia vomitoria Ref.
PlantaeApocynaceaeRauvolfia yunnanensis Ref.
PlantaeApocynaceaeRauwolfia serpentina Ref.
PlantaeRubiaceaeCorynanthe johimbe Ref.
PlantaeRubiaceaePausinystalia macroceras Ref.
PlantaeRubiaceaePausinystalia paniculata Ref.
PlantaeRubiaceaePausinystalia yohimbe Ref.
PlantaeRubiaceaePausinystalia yomhinbe Ref.
--Pausinylstalia yohimbe Ref.
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